RESEARCH PAPER · The European Physical Journal Plus · 2022
Theoretical investigation of lithium-based clusters Lin (where n = 3, 5, 7) with remarkable electronic and frequency-dependent NLO properties
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Geometric, Electronic, and Optoelectronic Properties of Carbon-Based Polynuclear C3O[C(CN)2]2M3 (where M = Li, Na, and K) Clusters: A DFT Study
Molecules · 2023-02-15
Imene Bayach, Atazaz Ahsin, Safi Ullah Majid, Umer Rashid, Nadeem S. Sheikh, Khurshid Ayub
Read original paper ↗ ·Theoretical study of static and frequency-dependent nonlinear optical properties of 1-phenyl-2,5-di(thiophen-2-yl)-1H-pyrrole based D-π-A chromophores through π-linkers modifications: A gateway towards giant nonlinear optical compounds
Materials Science and Engineering B · 2023-11-04
Muhammad Usman Khan, Sehar Nadeem, Aliha Fatima, Junaid Yaqoob, Faheem Abbas, Hany W. Darwish, Muhammad Ramzan Saeed Ashraf Janjua
Read original paper ↗ ·Nonlinear optical properties of KnCl (n = 2–7) superalkali clusters
Physica Scripta · 2024-05-30
Şükrü Şentürk, Fraidoon Fardad, Yavuz Ekíncíoğlu
Read original paper ↗ ·Change in nonlinear optical response of C24 nanocage upon doping with lithium based superalkalis
Physica Scripta · 2024-07-15
Naveen Kosar, Ayesha Safdar, Muhammad Imran, Adnan Younis, Tariq Mahmood
Read original paper ↗ ·Computational insights into the static, solvent and frequency-dependent nonlinear optical properties of head-to-tail novel non-fullerene compounds for modern electro-optic applications
Computational and Theoretical Chemistry · 2024-07-23
Maha Moteb Alotaibi
Read original paper ↗ ·Unveiling charge transfer kinetics and static-dynamic nonlinear optical switching in 2-phenylthiophene push-pull chromophores: DFT-based theoretical modelling for enhanced harmonic generation and electro-optic applications
Journal of Molecular Graphics and Modelling · 2025-04-26
Sehar Nadeem, Abida Anwar, Muhammad Usman Khan, Munazza Idrees, Mohamed A. El‐Tayeb, Mahmoud A. A. Ibrahim
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